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Ligand · GQG

GQG · N,N-dimethyl-1-[(4-phenylphenyl)methyl]pyridin-1-ium-4-amine

GQG, N,N-dimethyl-1-[(4-phenylphenyl)methyl]pyridin-1-ium-4-amine (C20 H21 N2 +1, 289.4 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5 Å, the residues it…

Component
GQG
Formula
C20 H21 N2 +1
Class
ligand
Structures
2
PDB entries
1

Binding sites

GQG in 2 structures; the first of them:

  • 4CG9 · Human choline kinase a1 in complex with compound 12 · GQG A0 · binds ASN305, ASP306, GLN308, TYR333, GLU349, TYR354, TRP420, TRP423 and 4 more
  • 4CG9 · Human choline kinase A1 in complex with compound 12 · GQG A0 · binds ASN305, ASP306, GLN308, TYR333, GLU349, TYR354, TRP420, TRP423 and 4 more

Residues it binds most

TYR 2, TRP 2, ARG 2, ASN 2, ASP 2, GLN 2, GLU 2, PHE 2 (residue and the binding sites it lines).

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